N-(2-ethanoylphenyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2-ethanoylphenyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2-acetylphenyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-acetylphenyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-acetylphenyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-acetylphenyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]acetamide Formula: C23H31N3O4+2 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H29N3O4/c1-18(27)21-5-3-4-6-22(21)24-23(28)17-26-13-11-25(12-14-26)15-16-30-20-9-7-19(29-2)8-10-20/h3-10H,11-17H2,1-2H3,(H,24,28)/p+2